1-(2-Hydroxyethoxymethyl)indole-3-carbonitrile

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吲哚及其衍生物
• 英文名称: 1-(2-Hydroxyethoxymethyl)indole-3-carbonitrile
• 化学式: C₁₂H₁₂N₂O₂
• 分子量: 216.239
• InChiKey: YLDWHBRDXXBCOY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.9
• 重原子数：
  16
• 可旋转键数：
  4
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  58.2
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  3-氰基吲哚 在 sodium methylate 、 sodium hydride 作用下， 以 甲醇 、 乙腈 为溶剂， 反应 2.5h， 生成 1-(2-Hydroxyethoxymethyl)indole-3-carbonitrile
  参考文献：
  名称：

  Glycosidopyrroles Part 3. Effect of the benzocondensation on acyclic derivatives: 1-(2-hydroxyethoxy) methylindoles as potential antiviral agents

  摘要：

  The new of 1-(2-hydroxyethoxy) methylindole derivatives 3a-i were prepared in good yields. None of them showed any significant anti-HIV activity and therefore the benzocondensation between the 2 and 3 positions of the pyrrole ring definitely reduced the weak activity found in the analogues 1a-c. (C) 1998 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0014-827x(98)00042-1

文献信息

• Glycosidopyrroles Part 3. Effect of the benzocondensation on acyclic derivatives: 1-(2-hydroxyethoxy) methylindoles as potential antiviral agents
  作者：Anna Maria Almerico、Paola Barraja、Patrizia Diana、Girolamo Cirrincione、Francesco Mingoia、Chiara Musiu、Graziella Perra、Monica Putzolu、Maria Elena Marongiu

  DOI：10.1016/s0014-827x(98)00042-1

  日期：1998.6

  The new of 1-(2-hydroxyethoxy) methylindole derivatives 3a-i were prepared in good yields. None of them showed any significant anti-HIV activity and therefore the benzocondensation between the 2 and 3 positions of the pyrrole ring definitely reduced the weak activity found in the analogues 1a-c. (C) 1998 Elsevier Science S.A. All rights reserved.

表征谱图